CID 26903

N,n-diisopropyltryptamine

Structural Information

Molecular Formula
C16H24N2
SMILES
CC(C)N(CCC1=CNC2=CC=CC=C21)C(C)C
InChI
InChI=1S/C16H24N2/c1-12(2)18(13(3)4)10-9-14-11-17-16-8-6-5-7-15(14)16/h5-8,11-13,17H,9-10H2,1-4H3
InChIKey
ZRVAAGAZUWXRIP-UHFFFAOYSA-N
Compound name
N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

265
Patents

244.19395 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.20123 159.8
[M+Na]+ 267.18317 171.0
[M+NH4]+ 262.22777 168.3
[M+K]+ 283.15711 166.1
[M-H]- 243.18667 162.2
[M+Na-2H]- 265.16862 165.2
[M]+ 244.19340 162.0
[M]- 244.19450 162.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe